Geometry & MOs

Info

ID:	234756
PubChem CID:	92303443
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	355.225977
ΔH_f, kcal/mol:	-77.46
Dipole, Da:	3.3
IP(EA), eV:	-9.2(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-benzylimidazol-2-yl)methyl]-3-methyl-N-[[(2R)-oxolan-2-yl]methyl]butanamide

Drug info:

PubChemData

Smile

COCC(=O)N(C[C@H]1CCCO1)CC2=NC=CN2CC3=CC=CC=C3

DOS

IR

Vibrations